Information card for entry 2102511

Structure parameters

• Chemical name: 3',6'-O-(1,1,3,3-Tetraisopropyl-disiloxane-1,3-diyl)-neplancin A
• Formula: C23 H39 N5 O4 Si2
• Calculated formula: C23 N5 O4 Si2
• SMILES: [Si]1(O[C@H]2[C@@H](O)[C@H](n3c4ncnc(N)c4nc3)C=C2CO[Si](O1)(C(C)C)C(C)C)(C(C)C)C(C)C
• Title of publication: 30 Space-group corrections: two examples of false polymorphism and one of incorrect interpretation of the fine details of an IR spectrum
• Authors of publication: Prof. Clemente Dore Augusto; Prof. Marzotto Armando
• Journal of publication: Acta Crystallographica Section B
• Year of publication: 2004
• Journal volume: 60
• Journal issue: 3
• Pages of publication: 287 - 292
• a: 13.1422 ± 0.0015 Å
• b: 12.1676 ± 0.0015 Å
• c: 34.638 ± 0.004 Å
• α: 90°
• β: 90°
• γ: 90°
• Cell volume: 5538.9 ± 1.1 ų
• Cell temperature: 0 K
• Number of distinct elements: 5
• Space group number: 20
• Hermann-Mauguin space group symbol: C 2 2 21
• Hall space group symbol: C 2c 2
• Diffraction radiation wavelength: 0.71073 Å
• Diffraction radiation type: MoK\α
• Has coordinates: Yes
• Has disorder: No
• Has Fobs: No